SCHEMBL8536635

SCHEMBL8536635

N[C@H]1N=C(c2ccccc2F)c2ccccc2N(Cc2cccnc2)C1=O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.45
KDM4E B2RXH2 2/20 0.43
ALDH1A1 P00352 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
UBE2N P61088 1/20 0.42
ATM Q13315 1/20 0.42
GNRHR P30968 1/20 0.41
HTT P42858 2/20 0.40
GABRP O00591 1/20 0.40
GABRD O14764 1/20 0.40
GABRA1 P14867 1/20 0.40
GABRB1 P18505 1/20 0.40
GABRG2 P18507 1/20 0.40
GABRB3 P28472 1/20 0.40
GABRA5 P31644 1/20 0.40
GABRA3 P34903 1/20 0.40
GABRA2 P47869 1/20 0.40
GABRB2 P47870 1/20 0.40
GABRA4 P48169 1/20 0.40
GABRE P78334 1/20 0.40

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8536629 1.00 LMNA (0.45) LMNAKDM4EALDH1A1TDP1UBE2N
SCHEMBL8538016 0.88 CCKBR (0.43) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL8538017 0.88 CCKBR (0.43) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL8537837 0.85 KDM4E (0.42) LMNAKDM4EALDH1A1TDP1UBE2N
SCHEMBL8537840 0.85 KDM4E (0.42) LMNAKDM4EALDH1A1TDP1UBE2N
SCHEMBL8538018 0.81 MEN1 (0.48) LMNAALDH1A1GNRHRGABRPGABRD
SCHEMBL8538022 0.81 MEN1 (0.48) LMNAALDH1A1GNRHRGABRPGABRD
SCHEMBL8535346 0.81 CCKBR (0.49) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL8535342 0.81 CCKBR (0.49) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL8535348 0.79 TP53 (0.42) LMNAGABRPGABRDGABRA1GABRB1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5763437-A Benzodiazepine derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-06-09 US disclosed
WO-1996004254-A2 BENZODIAZEPINE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-02-15 WO disclosed